Geometry & MOs

Info

ID:	155704
PubChem CID:	56367048
Reduced:	ClO2F3N5H13C18 (1)
Stoich.:	AB2C3D5E13F18 (1)
Weight, g/mol:	434.126006
ΔH_f, kcal/mol:	-138.88
Dipole, Da:	2.95
IP(EA), eV:	-9.44(-1.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methoxy-5-morpholin-4-ylsulfonyl-N-[2-oxo-2-(pyridin-3-ylamino)ethyl]benzamide

Drug info:

PubChemData

Smile

C1=CC(=CN=C1)NC(=O)CNC(=O)C2=C(N(N=C2)C3=CC=C(C=C3)Cl)C(F)(F)F

DOS

IR

Vibrations